SCHEMBL2903463

SCHEMBL2903463

O=C(C=Cc1ccc(Cl)c(Cl)c1)N1CCC(=O)N(CCN2CCCC(O)C2)CC1

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GPR183 P32249 6/20 0.49
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
CCR2 P41597 8/20 0.48
SLC2A1 P11166 2/20 0.42
PYGL P06737 2/20 0.42

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2921392 1.00 GPR183 (0.49) GPR183NPC1RAB9ATDP1CCR2
SCHEMBL2903460 1.00 GPR183 (0.49) GPR183NPC1RAB9ATDP1CCR2
SCHEMBL2921398 1.00 GPR183 (0.49) GPR183NPC1RAB9ATDP1CCR2
SCHEMBL2903464 1.00 GPR183 (0.49) GPR183NPC1RAB9ATDP1CCR2
SCHEMBL2902196 0.95 GPR183 (0.48) GPR183NPC1RAB9ATDP1CCR2
SCHEMBL4243628 0.95 GPR183 (0.48) GPR183NPC1RAB9ATDP1CCR2
SCHEMBL2902431 0.95 GPR183 (0.48) GPR183NPC1RAB9ATDP1CCR2
SCHEMBL2902434 0.95 GPR183 (0.48) GPR183NPC1RAB9ATDP1CCR2
SCHEMBL2902201 0.95 GPR183 (0.48) GPR183NPC1RAB9ATDP1CCR2
SCHEMBL2902180 0.95 GPR183 (0.48) GPR183NPC1RAB9ATDP1CCR2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2010506-B1 DIAZEPAN DERIVATIVES MODULATORS OF CHEMOKINE RECEPTORS HOFFMANN LA ROCHE (CH) 2010-08-04 EP disclosed